N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine

C13H23N3S — CID 112660524

IUPACN-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine
SMILESCCC(NC)c1ccc(N(C)CCSC)cn1
InChIInChI=1S/C13H23N3S/c1-5-12(14-2)13-7-6-11(10-15-13)16(3)8-9-17-4/h6-7,10,12,14H,5,8-9H2,1-4H3
InChIKeyBTRHUGCIBWENEU-UHFFFAOYSA-N
MW253.41 g/mol
LogP2.55
Rot. Bonds7

About N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine

N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine (PubChem CID 112660524) has the molecular formula C13H23N3S and a molecular weight of 253.41 g/mol. Its IUPAC name is N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine.

Molecular Properties

Compound NameN-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine
PubChem CID112660524
Molecular FormulaC13H23N3S
Molecular Weight253.41 g/mol
Exact Mass253.16
IUPAC NameN-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine
SMILESCCC(NC)c1ccc(N(C)CCSC)cn1
InChIInChI=1S/C13H23N3S/c1-5-12(14-2)13-7-6-11(10-15-13)16(3)8-9-17-4/h6-7,10,12,14H,5,8-9H2,1-4H3
InChIKeyBTRHUGCIBWENEU-UHFFFAOYSA-N
XLogP2.55
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-[1-(methylamino)ethyl]-N-(2-methylsulfanylethyl)pyridin-3-amine
CID 112660503
2-[methyl-[6-[1-(methylamino)propyl]-3-pyridinyl]amino]ethanol
CID 112584231
N-methyl-6-[1-(methylamino)propyl]-N-(2-phenylethyl)pyridin-3-amine
CID 115939684
N-methyl-6-[1-(methylamino)propyl]-N-(2-methylprop-2-enyl)pyridin-3-amine
CID 113498653
N-methyl-6-[1-(methylamino)propyl]-N-[(1-methylpyrazol-4-yl)methyl]pyridin-3-amine
CID 115939368
N-methyl-6-[1-(methylamino)propyl]-N-(4-methylphenyl)pyridin-3-amine
CID 115939523
N-methyl-6-[1-(methylamino)propyl]-N-[(2-methylfuran-3-yl)methyl]pyridin-3-amine
CID 115939341
N-methyl-4-[1-(methylamino)propyl]-N-(3-methylsulfanylpropyl)aniline
CID 114237191
6-[1-(ethylamino)propyl]-N-methyl-N-(3-methylbutyl)pyridin-3-amine
CID 112584276
3-[methyl-[6-[1-(methylamino)propyl]-3-pyridinyl]amino]butanenitrile
CID 112584427
N-methyl-6-[1-(methylamino)propyl]-N-(oxan-4-yl)pyridin-3-amine
CID 112584222
N-methyl-N-(3-methylbutyl)-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939346

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine?
The IUPAC name of N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine (CID 112660524) is N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine.
What is the SMILES notation for N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine?
The canonical SMILES for N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine is CCC(NC)c1ccc(N(C)CCSC)cn1.
What is the InChIKey of N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine?
The InChIKey is BTRHUGCIBWENEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3S/c1-5-12(14-2)13-7-6-11(10-15-13)16(3)8-9-17-4/h6-7,10,12,14H,5,8-9H2,1-4H3.
What are the key properties of N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine?
N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine has a molecular weight of 253.41 g/mol, XLogP of 2.55, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[1-(methylamino)propyl]-N-(2-methylsulfanylethyl)pyridin-3-amine is sourced from PubChem (CID 112660524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).